ethane;(Z)-2-(prop-2-enylideneamino)ethenamine

C9H20N2 — CID 143375467

IUPACethane;(Z)-2-(prop-2-enylideneamino)ethenamine
SMILESC=C/C=N/C=C\N.CC.CC
InChIInChI=1S/C5H8N2.2C2H6/c1-2-4-7-5-3-6;2*1-2/h2-5H,1,6H2;2*1-2H3/b5-3-,7-4+;;
InChIKeyBYTOWVVBSPZCKQ-LDYQANPCSA-N
MW156.27 g/mol
LogP2.73
Rot. Bonds2

About ethane;(Z)-2-(prop-2-enylideneamino)ethenamine

ethane;(Z)-2-(prop-2-enylideneamino)ethenamine (PubChem CID 143375467) has the molecular formula C9H20N2 and a molecular weight of 156.27 g/mol. Its IUPAC name is ethane;(Z)-2-(prop-2-enylideneamino)ethenamine.

Molecular Properties

Compound Nameethane;(Z)-2-(prop-2-enylideneamino)ethenamine
PubChem CID143375467
Molecular FormulaC9H20N2
Molecular Weight156.27 g/mol
Exact Mass156.16
IUPAC Nameethane;(Z)-2-(prop-2-enylideneamino)ethenamine
SMILESC=C/C=N/C=C\N.CC.CC
InChIInChI=1S/C5H8N2.2C2H6/c1-2-4-7-5-3-6;2*1-2/h2-5H,1,6H2;2*1-2H3/b5-3-,7-4+;;
InChIKeyBYTOWVVBSPZCKQ-LDYQANPCSA-N
XLogP2.73
TPSA38.38 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500156.27
LogP ≤ 52.73
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}

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Related Compounds

Penta-1,3-diene, 1-ethylamino-5-ethylimino-
CID 74051061
N-methyl-N'-methylideneprop-2-ene-1,3-diimine
CID 91606293
3-(4-Fluorobutylimino)prop-1-en-1-amine
CID 173874941
(Z)-N-methyl-3-methyliminoprop-1-en-1-amine
CID 10606703
N-(3-methylamino-2-propenylidene)methylamine
CID 85203886
[1,4,7]Triazacycloundecin
CID 129814489
(E)-N-methyl-3-methyliminoprop-1-en-1-amine
CID 12425496
(1E,3E,5E)-N-methyl-7-methyliminohepta-1,3,5-trien-1-amine
CID 20641198
N-methyl-7-methyliminohepta-1,3,5-trien-1-amine
CID 54130969
Methyl-[11-(methylamino)undeca-2,4,6,8,10-pentaenylidene]azanium
CID 54285233
Dimethyl-[7-(methylamino)hepta-2,4,6-trienylidene]azanium
CID 54410989
methyl-[(2E,4E,6E,8E)-9-(methylamino)nona-2,4,6,8-tetraenylidene]azanium
CID 54465327

Frequently Asked Questions

What is the IUPAC name of ethane;(Z)-2-(prop-2-enylideneamino)ethenamine?
The IUPAC name of ethane;(Z)-2-(prop-2-enylideneamino)ethenamine (CID 143375467) is ethane;(Z)-2-(prop-2-enylideneamino)ethenamine.
What is the SMILES notation for ethane;(Z)-2-(prop-2-enylideneamino)ethenamine?
The canonical SMILES for ethane;(Z)-2-(prop-2-enylideneamino)ethenamine is C=C/C=N/C=C\N.CC.CC.
What is the InChIKey of ethane;(Z)-2-(prop-2-enylideneamino)ethenamine?
The InChIKey is BYTOWVVBSPZCKQ-LDYQANPCSA-N. The full InChI is InChI=1S/C5H8N2.2C2H6/c1-2-4-7-5-3-6;2*1-2/h2-5H,1,6H2;2*1-2H3/b5-3-,7-4+;;.
What are the key properties of ethane;(Z)-2-(prop-2-enylideneamino)ethenamine?
ethane;(Z)-2-(prop-2-enylideneamino)ethenamine has a molecular weight of 156.27 g/mol, XLogP of 2.73, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for ethane;(Z)-2-(prop-2-enylideneamino)ethenamine is sourced from PubChem (CID 143375467), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).